SCHEMBL8969401

SCHEMBL8969401

N=c1c2c(Cl)cc(Cl)cc2nc2cccc(F)n12

nearest known ligand 0.34

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PDE2A O00408 1/20 0.34
PDE10A Q9Y233 1/20 0.34
GAA P10253 3/20 0.31
LMNA P02545 1/20 0.31
HTT P42858 1/20 0.31
KDM4E B2RXH2 2/20 0.31
ALDH1A1 P00352 2/20 0.31
GLA P06280 2/20 0.31
POLB P06746 2/20 0.31
HPGD P15428 2/20 0.31
MEN1 O00255 1/20 0.31
NPC1 O15118 1/20 0.31
MAPT P10636 1/20 0.31
RAB9A P51151 1/20 0.31
KMT2A Q03164 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
HSD17B10 Q99714 1/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL8969207 0.85 GAA (0.41) PDE2APDE10AGAALMNAHTT
SCHEMBL8969761 0.83 HTT (0.42) PDE2APDE10AGAALMNAHTT
SCHEMBL8968968 0.74 KDM4E (0.53) GAALMNAKDM4EALDH1A1GLA
SCHEMBL8969480 0.73 HTR6 (0.39) GAAKDM4EALDH1A1GLAPOLB
SCHEMBL8969266 0.73 CYP11B1 (0.34) GAAKDM4EALDH1A1GLAPOLB
SCHEMBL8970270 0.71 HTR6 (0.41) GAAKDM4EALDH1A1GLAPOLB
SCHEMBL8969226 0.71 KDM4E (0.38) GAAKDM4EALDH1A1GLAPOLB
SCHEMBL8969345 0.68 NR1H4 (0.39) GAAKDM4EALDH1A1POLBNPC1
SCHEMBL8969355 0.68 HTR6 (0.41) GAALMNAKDM4EALDH1A1GLA
SCHEMBL8968984 0.68 PDE2A (0.36) PDE2APDE10AGAAKDM4EALDH1A1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5486512-A LEARNING ENHANCEMENT WARNER-LAMBERT COMPANY (US) 1996-01-23 US disclosed
WO-1993003034-A1 QUINAZOLINE DERIVATIVES AS ACETYLCHOLINESTERASE INHIBITORS WARNER-LAMBERT COMPANY (US) 1993-02-18 WO disclosed